5-Fluoro-1-naphthaldehyde

CAT: 0127-PC2874-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC2874-01Size:1 g

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CAS Number

110931-86-7

Synonyms

5-Fluoronaphthalene-1-carboxaldehyde, 1-Fluoro-5-formylnaphthalene

MDL Number

MFCD09258965

Purity

98%

Smiles

Fc1cccc2c(C=O)cccc12

Chemical Information

5-Fluoro-1-naphthaldehyde

CAS Number	110931-86-7
PubChem CID	14368708
IUPAC Name	5-fluoronaphthalene-1-carbaldehyde
Molecular Formula	C11H7FO
Molecular Weight	174.17
XLogP	2.7
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	193

SMILES

C1=CC(=C2C=CC=C(C2=C1)F)C=O

InChI

InChI=1S/C11H7FO/c12-11-6-2-4-9-8(7-13)3-1-5-10(9)11/h1-7H

InChIKey

JJFWJEXWKQDOJL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 110931-86-7

CID: 14368708

Formula: C11H7FO

MW: 174.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	174.17
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	174.048093005
Monoisotopic Mass	174.048093005
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC5696-01	1-Fluoro-2-naphthaldehyde
PC409500-01	4-Fluoro-1-naphthaldehyde
OR1005734	5-Bromo-1-naphthaldehyde
PC1027138-01	6-Fluoro-2-naphthaldehyde
PC1020239-01	4-fluoro-3- (methoxymethyl) -1-naphthaldehyde
PC1018094-01	4-Fluoro-3-methyl-1-naphthaldehyde
PC1018288-01	1-Fluoro-4-iodo-2-naphthaldehyde
PC1018092-01	4-Fluoro-3- (methylthio) -1-naphthaldehyde
PC1026155	4-Bromo-1-fluoro-2-naphthaldehyde
OR5195-01	1-Naphthaldehyde

Catalog	Name
sc-262594A	5-Fluoro-1-naphthaldehyde
409769-01	1-Fluoro-2-naphthaldehyde
MBS6056986-01	4-Fluoro-1-naphthaldehyde
114250 500	1-Naphthaldehyde for Synthesis (α-Naphthaldehyde)
abx182902-01	1-Naphthaldehyde
MBS6094420-01	1-Naphthaldehyde-d7
CCA80548	2- (Benzyloxy) -1-naphthaldehyde
TRC-B688455-1G	1-Bromo-2-naphthaldehyde
283009-01	4-Methoxy-1-naphthaldehyde
282121-01	7-Methoxy-1-naphthaldehyde